Benzylaniline hydrochloride
TL;DR: Benzylaniline hydrochloride (CAS 2290-89-3) is a chemical compound with molecular formula C13H14ClN and molecular weight 219.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzylaniline;hydrochloride
Also Known As: benzylaniline hydrochloride, N-benzylaniline hydrochloride, N-benzylaniline,hydrochloride, Benzenemethanamine, hydrochloride, Benzenemethanamine, N-phenyl-, hydrochloride
| Molecular Formula | C13H14ClN |
|---|---|
| Molecular Weight | 219.08 g/mol |
| LogP | 3.7205 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.08148 |
| Heavy Atoms | 15 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 2290-89-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=CC=CC=C2.Cl |
| InChIKey | VHJHGGJFAZIZNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzylaniline hydrochloride (CAS 2290-89-3), with molecular formula C13H14ClN and molecular weight 219.08 g/mol. IUPAC: N-benzylaniline;hydrochloride.
Chemical Property Profile of Benzylaniline hydrochloride
Property Insights of Benzylaniline hydrochloride
The XLogP value of 3.7205 indicates that Benzylaniline hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Benzylaniline hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylaniline hydrochloride has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzylaniline hydrochloride?
The CAS number of Benzylaniline hydrochloride is 2290-89-3.
What is the molecular formula of Benzylaniline hydrochloride?
The molecular formula of Benzylaniline hydrochloride is C13H14ClN.
What is the molecular weight of Benzylaniline hydrochloride?
The molecular weight of Benzylaniline hydrochloride is 219.08 g/mol.
Where can I buy Benzylaniline hydrochloride?
You can request a quote for Benzylaniline hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylaniline hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzylaniline hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.